SCHEMBL20519997

SCHEMBL20519997

CCOC(=O)[C@@H]1C[C@H]1CC#N

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CA1 P00915 10/20 0.44
CA2 P00918 10/20 0.44
CA9 Q16790 8/20 0.44
CA12 O43570 7/20 0.44
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
ALDH1A1 P00352 2/20 0.37
KDM4E B2RXH2 1/20 0.37
GAA P10253 1/20 0.37
RECQL P46063 1/20 0.37
HSD17B10 Q99714 1/20 0.37
TSHR P16473 1/20 0.35
PPM1B O75688 1/20 0.33
PTPN1 P18031 1/20 0.33
PPP1CC P36873 1/20 0.33
CAPN9 O14815 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL20519996 1.00 CA1 (0.44) CA1CA2CA9CA12MEN1
SCHEMBL25939820 1.00 CA1 (0.44) CA1CA2CA9CA12MEN1
SCHEMBL8140195 0.81 CHRM2 (0.35) CA1CA2CA9CA12HSD17B10
SCHEMBL11364765 0.81 ALDH1A1 (0.38) CA1CA2CA12MEN1KMT2A
SCHEMBL15927849 0.79 CA1 (0.50) CA1CA2CA9CA12ALDH1A1
SCHEMBL13868765 0.79 CA1 (0.50) CA1CA2CA9CA12ALDH1A1
SCHEMBL6871204 0.79 CA1 (0.50) CA1CA2CA9CA12ALDH1A1
SCHEMBL12889180 0.79 CA1 (0.50) CA1CA2CA9CA12ALDH1A1
SCHEMBL17407788 0.79 CA1 (0.50) CA1CA2CA9CA12ALDH1A1
SCHEMBL11946139 0.79 CA1 (0.50) CA1CA2CA9CA12ALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3601284-B1 NAPHTHYRIDINES AS INHIBITORS OF HPK1 HOFFMANN LA ROCHE (CH) 2023-12-27 EP disclosed
US-11034692-B1 Naphthyridines as inhibitors of HPK1 GENENTECH, INC. (US) 2021-06-15 US disclosed
EP-3601284-A1 NAPHTHYRIDINES AS INHIBITORS OF HPK1 H. Hoffnabb-La Roche Ag (CH) 2020-02-05 EP disclosed
US-10407424-B2 Naphthyridines as inhibitors of HPK1 GENENTECH, INC. (US) 2019-09-10 US disclosed
US-20180282328-A1 NAPHTHYRIDINES AS INHIBITORS OF HPK1 GENENTECH, INC. (US) 2018-10-04 US disclosed
WO-2018183956-A1 NAPHTHYRIDINES AS INHIBITORS OF HPK1 GENENTECH, INC. (US) 2018-10-04 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10407424-B2 Naphthyridines as inhibitors of HPK1 NEK1, NEK5, NEK11 CA1 4815/4885CA2 4661/4885CA9 4504/4885
US-20180282328-A1 NAPHTHYRIDINES AS INHIBITORS OF HPK1 NEK1, NEK5, NEK11 CA1 4815/4885CA2 4661/4885CA9 4504/4885
US-11034692-B1 Naphthyridines as inhibitors of HPK1 NEK1, NEK5, NEK11 CA1 4815/4885CA2 4661/4885CA9 4504/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.